N-[1-[4-(phenylmethyl)piperazin-1-yl]-1-thiophen-2-yl-propan-2-yl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[1-[4-(phenylmethyl)piperazin-1-yl]-1-thiophen-2-yl-propan-2-yl]-9H-xanthene-9-carboxamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-1-methyl-2-(2-thienyl)ethyl]-9H-xanthene-9-carboxamide CAS Name: N-[1-[4-(phenylmethyl)-1-piperazinyl]-1-thiophen-2-ylpropan-2-yl]-9H-xanthene-9-carboxamide IUPAC Name: N-[1-(4-benzylpiperazin-1-yl)-1-thiophen-2-ylpropan-2-yl]-9H-xanthene-9-carboxamide Traditional Name: N-[2-(4-benzylpiperazino)-1-methyl-2-(2-thienyl)ethyl]-9H-xanthene-9-carboxamide Formula: C32H33N3O2S MolecularWeight: 523.68832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CS1)N2CCN(CC2)CC3=CC=CC=C3)NC(=O)C4C5=CC=CC=C5OC6=CC=CC=C46

Isomeric SMILES

CC(C(C1=CC=CS1)N2CCN(CC2)CC3=CC=CC=C3)NC(=O)C4C5=CC=CC=C5OC6=CC=CC=C46

InChI

InChI=1S/C32H33N3O2S/c1-23(33-32(36)30-25-12-5-7-14-27(25)37-28-15-8-6-13-26(28)30)31(29-16-9-21-38-29)35-19-17-34(18-20-35)22-24-10-3-2-4-11-24/h2-16,21,23,30-31H,17-20,22H2,1H3,(H,33,36)